Pomiferin

Base Information

• Chemical Name: Pomiferin
• CAS No.: 572-03-2
• Molecular Formula: C25H24O6
• Molecular Weight: 420.462
• NSC Number: 5113
• UNII: 74YIS40APM
• DSSTox Substance ID: DTXSID00205831
• Nikkaji Number: J11.514B
• Wikipedia: Pomiferin
• Wikidata: Q25323752
• Metabolomics Workbench ID: 22381
• ChEMBL ID: CHEMBL393136
• Mol file: 572-03-2.mol

Synonyms:3-(3,4-dihydroxyphenyl)-5-hydroxy-8,8-dimethyl-6-(3-methylbut-2-enyl)-4H,8H-pyrano(2,3-h)chromen-4-one;pomiferin

Chemical Property of Pomiferin

Chemical Property:

• Vapor Pressure: 9.37E-19mmHg at 25°C
• Melting Point: >300℃
• Boiling Point: 673.5°Cat760mmHg
• PKA: 6.85±0.40(Predicted)
• Flash Point: 233.3°C
• PSA: 100.13000
• Density: 1.314g/cm³
• LogP: 5.26970
• XLogP3: 5.5
• Hydrogen Bond Donor Count: 3
• Hydrogen Bond Acceptor Count: 6
• Rotatable Bond Count: 3
• Exact Mass: 420.15728848
• Heavy Atom Count: 31
• Complexity: 792

Purity/Quality:

≥95% ^*data from raw suppliers

Pomiferin ^*data from reagent suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC(=CCC1=C2C(=C3C(=C1O)C(=O)C(=CO3)C4=CC(=C(C=C4)O)O)C=CC(O2)(C)C)C
• Uses: Pomiferin is a useful research chemical compound.

Technology Process of Pomiferin

There total 1 articles about Pomiferin which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield:

→ pomiferin (572-03-2)

Guidance literature:

Isoflavon 20, DDQ/Bzl. <Δ>;

DOI:10.1021/jo00412a004

Reference yield: 82.0%

methanol (67-56-1) + dipyridil[3,2-a:2',3'-c]phenazine (19535-47-8) + copper(II) nitrate trihydrate + pomiferin (572-03-2) → (3-(3,4-dihydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one-5-olato-κ2O4:O5)(dipyrido[3,2-a:2',3'-c]phenazine–κ2N4:N5)copper(II)nitrate methanol solvate

Guidance literature:

With triethylamine; at 65 ℃; for 1h;

DOI:10.3390/ijms22147626

Reference yield: 78.0%

methanol (67-56-1) + 1,10-Phenanthroline (66-71-7) + copper(II) nitrate trihydrate + pomiferin (572-03-2) → (3-(3,4-dihydroxyphenyl)-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4H,8H-benzo[1,2-b:3,4-b']dipyran-4-one-5-olato-κ2O4:O5)(1,10-phenanthroline–κ2N:N)copper(II) nitrate methanol disolvate

Guidance literature:

With triethylamine; at 65 ℃; for 1h;

DOI:10.3390/ijms22147626

Downstream raw materials:

dihydroisopomiferin

3-[3,4-bis-(toluene-4-sulfonyloxy)-phenyl]-5-hydroxy-8,8-dimethyl-6-(3-methyl-but-2-enyl)-8H-pyrano[2,3-f]chromen-4-one

isopomiferin

4-(5-acetoxy-8,8-dimethyl-6-(3-methylbut-2-en-1-yl)-4-oxo-4H,8H-pyrano[2,3-f]chromen-3-yl)-1,2-phenylene diacetate